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CHEBI:179088 - PC(13:0/18:2(9Z,12Z))

ChEBI IDCHEBI:179088
ChEBI NamePC(13:0/18:2(9Z,12Z))
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DownloadsMolfile
FormulaC39H74NO8P
Net Charge0
Average Mass715.994
Monoisotopic Mass715.51520
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C39H74NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40(3,4)5)35-45-38(41)31-29-27-25-23-17-15-13-11-9-7-2/h14,16,19-20,37H,6-13,15,17-18,21-36H2,1-5H3/b16-14-,20-19-/t37-/m1/s1
InChIKeyVYIZOJIGQOJWGL-HFWMYYSASA-N
ChEBI Ontology
Outgoing Relation(s)
PC(13:0/18:2(9Z,12Z)) (CHEBI:179088) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-tridecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP01011348LIPID MAPS
75319923ChemSpider